SCHEMBL7440252

SCHEMBL7440252

CNCc1ccc2oc(-c3ccccc3C#N)cc2c1

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAOB P27338 7/20 0.46
MAOA P21397 6/20 0.46
PRKCQ Q04759 6/20 0.39
PRKCD Q05655 6/20 0.39
HTR7 P34969 2/20 0.38
FFAR1 O14842 1/20 0.37
HRH3 Q9Y5N1 1/20 0.37
MYC P01106 1/20 0.37
WDR5 P61964 1/20 0.37
LOXL2 Q9Y4K0 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL7437915 0.84 MAOB (0.42) MAOBMAOAPRKCQPRKCDFFAR1
SCHEMBL27370060 0.82 FFAR1 (0.42) MAOBMAOAPRKCQPRKCDFFAR1
SCHEMBL8481860 0.80 MAOB (0.62) MAOBMAOA
SCHEMBL5034698 0.77 MAOB (0.57) MAOBMAOAPRKCQPRKCD
SCHEMBL8179409 0.77 MAOB (0.48) MAOBMAOA
SCHEMBL8487461 0.74 MAOB (0.40) MAOBMAOAPRKCQPRKCDMYC
SCHEMBL7442248 0.74 HTR7 (0.36) HTR7MYCWDR5
SCHEMBL1602282 0.74 S1PR1 (0.48) MAOBMAOAFFAR1HDAC6
SCHEMBL8482882 0.74 MAOB (0.39) MAOBMAOAPRKCQPRKCDMYC
SCHEMBL8808908 0.73 MAOB (0.39) MAOBMAOAPRKCQPRKCDHRH3

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0628559-B1 Pyrimidine compounds and their use as pharmaceuticals BEIERSDORF LILLY GMBH (DE) 2002-04-03 EP disclosed
US-5602136-A Pyrimidine compounds and their use as pharmaceuticals BEIERSDORF-LILLY GMBH (DE) 1997-02-11 US disclosed
US-5602137-A Pyrimidine compounds and their use as pharmaceuticals BEIERSDORF-LILLY GMBH (DE) 1997-02-11 US disclosed
US-5571813-A Fused pyrimidine compounds and their use as pharmaceuticals BEIERSDORF-LILLY GMBH (DE) 1996-11-05 US disclosed
EP-0628559-A1 Pyrimidine compounds and their use as pharmaceuticals Beiersdorf-Lilly GmbH (DE) 1994-12-14 EP disclosed